4-(3-ethyl-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)-2-fluoranyl-6-[2-(1H-imidazol-2-ylmethylsulfanyl)ethylamino]benzamide

Systemtic Name: 4-(3-ethyl-6,6-dimethyl-4-oxidanylidene-5,7-dihydroindazol-1-yl)-2-fluoranyl-6-[2-(1H-imidazol-2-ylmethylsulfanyl)ethylamino]benzamide Openeye Name: 4-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-2-fluoro-6-[2-(1H-imidazol-2-ylmethylsulfanyl)ethylamino]benzamide CAS Name: 4-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-2-fluoro-6-[2-(1H-imidazol-2-ylmethylthio)ethylamino]benzamide IUPAC Name: 4-(3-ethyl-6,6-dimethyl-4-oxo-5,7-dihydroindazol-1-yl)-2-fluoro-6-[2-(1H-imidazol-2-ylmethylsulfanyl)ethylamino]benzamide Traditional Name: 4-(3-ethyl-4-keto-6,6-dimethyl-5,7-dihydroindazol-1-yl)-2-fluoro-6-[2-(1H-imidazol-2-ylmethylthio)ethylamino]benzamide Formula: C24H29FN6O2S MolecularWeight: 484.589463

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Descriptors Computed from Structure

Canonical SMILES:

CCC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC(=C(C(=C3)F)C(=O)N)NCCSCC4=NC=CN4

Isomeric SMILES

CCC1=NN(C2=C1C(=O)CC(C2)(C)C)C3=CC(=C(C(=C3)F)C(=O)N)NCCSCC4=NC=CN4

InChI

InChI=1S/C24H29FN6O2S/c1-4-16-22-18(11-24(2,3)12-19(22)32)31(30-16)14-9-15(25)21(23(26)33)17(10-14)27-7-8-34-13-20-28-5-6-29-20/h5-6,9-10,27H,4,7-8,11-13H2,1-3H3,(H2,26,33)(H,28,29)